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CAS 2571-39-3 3,4-Dimethylbenzophenone molecular structure lightbox
CAS RN: 2571-39-3

3,4-Dimethylbenzophenone

Product Availability

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4 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260129 100g In stock Shanghai, Shenzhen, Wuhan, Chengdu Inquiry
Batchno.20260327 1kg Out of stock Inquiry
Batchno.20250918 25g In stock Shanghai, Shenzhen Inquiry
Batchno.20260522 500g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
  • Product code: SSC-122167
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 10g, 25g, 100g
  • Available purity: ≥98%
  • Inventory rows with stock: 3
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 2571-39-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
10g ≥98% 5 In Stock Shanghai Inquiry
25g ≥98% 5 In Stock Shanghai Inquiry
100g ≥98% 5 In Stock Shanghai Inquiry

2571-39-3 / (3,4-dimethylphenyl)-phenylmethanone

Standard CAS: 2571-39-3 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
2571-39-3
Multi CAS
No
Molecular Formula
C15H14O
Molecular Weight
210.270000
Exact Mass
210.104465
SMILES
CC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2)C
InChI
InChI=1S/C15H14O/c1-11-8-9-14(10-12(11)2)15(16)13-6-4-3-5-7-13/h3-10H,1-2H3
InChIKey
JENOLWCGNVWTJN-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
16
Aromatic heavy atom count
12
Fraction Csp3
0.13
Rotatable bonds
2
H-bond acceptors
1
Molar refractivity
65.79
TPSA
17.07

LogP / Solubility

WLOGP
3.53
MLOGP
3.11
XLogP3
4.5
Consensus LogP
3.71
Log S (ESOL)
-3.79
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.84
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.2
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.49

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

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